3-[3-(1-azanylethenylamino)propyl]-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidine-2-carboxylic acid

Systemtic Name: 3-[3-(1-azanylethenylamino)propyl]-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidine-2-carboxylic acid Openeye Name: 3-[3-(1-aminovinylamino)propyl]-1-(benzylcarbamoyl)-4-oxo-azetidine-2-carboxylic acid CAS Name: 3-[3-(1-aminoethenylamino)propyl]-4-oxo-1-[oxo-[(phenylmethyl)amino]methyl]-2-azetidinecarboxylic acid IUPAC Name: 3-[3-(1-aminoethenylamino)propyl]-1-(benzylcarbamoyl)-4-oxoazetidine-2-carboxylic acid Traditional Name: 3-[3-(1-aminovinylamino)propyl]-1-(benzylcarbamoyl)-4-keto-azetidine-2-carboxylic acid Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

C=C(N)NCCCC1C(N(C1=O)C(=O)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C=C(N)NCCCC1C(N(C1=O)C(=O)NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H22N4O4/c1-11(18)19-9-5-8-13-14(16(23)24)21(15(13)22)17(25)20-10-12-6-3-2-4-7-12/h2-4,6-7,13-14,19H,1,5,8-10,18H2,(H,20,25)(H,23,24)